Aethylstyrylcarbinol
TL;DR: Aethylstyrylcarbinol (CAS 88765-29-1) is a chemical compound with molecular formula C11H14O and molecular weight 162.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenylpent-1-en-3-ol
Also Known As: Aethylstyrylcarbinol, 1-Penten-3-ol, 1-phenyl-, (E)-, 1-Penten-3-ol, 1-phenyl-, (S)-, 1-Penten-3-ol, 1-phenyl-, (3R)-, 1-Penten-3-ol, 1-phenyl-, (1E,3R)-
| Molecular Formula | C11H14O |
|---|---|
| Molecular Weight | 162.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 162.10446 |
| Heavy Atoms | 12 |
| Complexity | 134.0 |
Chemical Identifiers
| CAS Number | 88765-29-1 |
|---|---|
| SMILES | CCC(C=CC1=CC=CC=C1)O |
| InChIKey | MPQYLVUGJQUTPM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Aethylstyrylcarbinol (CAS 88765-29-1), with molecular formula C11H14O and molecular weight 162.10 g/mol. IUPAC: 1-phenylpent-1-en-3-ol.
Chemical Property Profile of Aethylstyrylcarbinol
Property Insights of Aethylstyrylcarbinol
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aethylstyrylcarbinol. With a topological polar surface area (TPSA) of 20.2 Ų, Aethylstyrylcarbinol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aethylstyrylcarbinol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Aethylstyrylcarbinol?
The CAS number of Aethylstyrylcarbinol is 88765-29-1.
What is the molecular formula of Aethylstyrylcarbinol?
The molecular formula of Aethylstyrylcarbinol is C11H14O.
What is the molecular weight of Aethylstyrylcarbinol?
The molecular weight of Aethylstyrylcarbinol is 162.10 g/mol.
Where can I buy Aethylstyrylcarbinol?
You can request a quote for Aethylstyrylcarbinol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aethylstyrylcarbinol?
Yes, KEHONG BIO provides custom synthesis services for Aethylstyrylcarbinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.